(2R,4S)-1-(6-chloranyl-3-nitro-pyridin-1-ium-2-yl)-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-1-(6-chloranyl-3-nitro-pyridin-1-ium-2-yl)-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-1-(6-chloro-3-nitro-pyridin-1-ium-2-yl)-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-(6-chloro-3-nitro-2-pyridin-1-iumyl)-4-hydroxy-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-1-(6-chloro-3-nitropyridin-1-ium-2-yl)-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-(6-chloro-3-nitro-pyridin-1-ium-2-yl)-4-hydroxy-pyrrolidine-2-carboxylate Formula: C10H10ClN3O5 MolecularWeight: 287.6565

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)[O-])C2=C(C=CC(=[NH+]2)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1[C@@H](CN([C@H]1C(=O)[O-])C2=C(C=CC(=[NH+]2)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C10H10ClN3O5/c11-8-2-1-6(14(18)19)9(12-8)13-4-5(15)3-7(13)10(16)17/h1-2,5,7,15H,3-4H2,(H,16,17)/t5-,7+/m0/s1